Chem
J-GLOBAL ID：200907042035009757
Nikkaji number：J727.021F
(2S,3S)-2,3-Dihydro-2,3-dihydroxybenzoate
5α,6β-ジヒドロキシ-1,3-シクロヘキサジエン-1-カルボン酸
Substance type
Substance type classified into 3 categories.
Decided structure: Substances with a clear structure
Undicided Structure: Substances with unknown or undetermined structure
Mixtures: Mixtures, racemic compounds, or compounds with relative structural arrangements
Decided structure
Substance type classified into 3 categories.
Decided structure: Substances with a clear structure
Undicided Structure: Substances with unknown or undetermined structure
Mixtures: Mixtures, racemic compounds, or compounds with relative structural arrangements
Molecular formula： C7H8O4
Molecular formula furigana： C7-H8-O4
Molecular weight： 156.137
InChI：
InChI=1S/C7H8O4/c8-5-3-1-2-4(6(5)9)7(10)11/h1-3,5-6,8-9H,(H,10,11)/t5-,6-/m0/s1
InChI key：
INCSWYKICIYAHB-WDSKDSINSA-N
SMILES：
O[C@H]1C=CC=C([C@@H]1O)C(=O)O
Systematic name (8)：
- (2S,3S)-2,3-ジヒドロキシシクロヘキサ-1(6),4-ジエン-1-カルボン酸
- (5S,6S)-5,6-ジヒドロキシ-1,3-シクロヘキサジエン-1-カルボン酸
- (5S)-5α,6β-ジヒドロキシ-1,3-シクロヘキサジエン-1-カルボン酸
- 5α,6β-ジヒドロキシ-1,3-シクロヘキサジエン-1-カルボン酸
- (2S,3S)-2,3-ジヒドロキシ-1(6),4-シクロヘキサジエン-1-カルボン酸
Show all
- (2S,3S)-2,3-Dihydroxycyclohexa-1(6),4-diene-1-carboxylic acid
- (5S,6S)-5,6-Dihydroxy-1,3-cyclohexadiene-1-carboxylic acid
- (5S)-5α,6β-Dihydroxy-1,3-cyclohexadiene-1-carboxylic acid
- 5α,6β-Dihydroxy-1,3-cyclohexadiene-1-carboxylic acid
- (2S,3S)-2,3-Dihydroxy-1(6),4-cyclohexadiene-1-carboxylic acid
Show all
KEGG COMPOUND：
C04171
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